3,5,7-Trihydroxy-2-[4-Hydroxy-3-Methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Chromen-4-One
[CAS# 123442-26-2]

Identification

• Name: 3,5,7-Trihydroxy-2-[4-Hydroxy-3-Methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Chromen-4-One
• Synonyms: 3,5,7-Trihydroxy-2-[4-Hydroxy-3-Methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Phenyl]Chromen-4-One; 3,5,7-Trihydroxy-2-[4-Hydroxy-3-Methoxy-5-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]-4-Chromenone; 3,5,7-Trihydroxy-2-[4-Hydroxy-3-Methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Phenyl]Chromone
• Molecular Formula: C₂₂H₂₂O₁₃
• Molecular Weight: 494.41
• CAS Registry Number: 123442-26-2
• SMILES: [C@@H]4(OC1=CC(=CC(=C1O)OC)C3=C(O)C(=O)C2=C(O)C=C(O)C=C2O3)O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO
• InChI: 1S/C22H22O13/c1-32-11-2-7(21-19(30)17(28)14-9(25)4-8(24)5-10(14)33-21)3-12(15(11)26)34-22-20(31)18(29)16(27)13(6-23)35-22/h2-5,13,16,18,20,22-27,29-31H,6H2,1H3/t13-,16-,18+,20-,22-/m1/s1
• InChIKey: RUJHFBFKZCYVLZ-ROSPJSJWSA-N